N-butyl-2-chloranyl-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide

Systemtic Name: N-butyl-2-chloranyl-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide Openeye Name: N-butyl-2-chloro-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide CAS Name: N-butyl-2-chloro-N-[(1-methyl-2-pyrrolyl)methyl]-4-nitrobenzamide IUPAC Name: N-butyl-2-chloro-N-[(1-methylpyrrol-2-yl)methyl]-4-nitrobenzamide Traditional Name: N-butyl-2-chloro-N-[(1-methylpyrrol-2-yl)methyl]-4-nitro-benzamide Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1C)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCCN(CC1=CC=CN1C)C(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H20ClN3O3/c1-3-4-10-20(12-14-6-5-9-19(14)2)17(22)15-8-7-13(21(23)24)11-16(15)18/h5-9,11H,3-4,10,12H2,1-2H3